N-[4-methyl-3-(methylsulfamoyl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide

C18H17N3O4S — CID 39441482

IUPACN-[4-methyl-3-(methylsulfamoyl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide
SMILESCNS(=O)(=O)c1cc(NC(=O)c2cc(-c3ccccc3)on2)ccc1C
InChIInChI=1S/C18H17N3O4S/c1-12-8-9-14(10-17(12)26(23,24)19-2)20-18(22)15-11-16(25-21-15)13-6-4-3-5-7-13/h3-11,19H,1-2H3,(H,20,22)
InChIKeyCZPHVCSTHBOSSK-UHFFFAOYSA-N
MW371.42 g/mol
LogP2.81
Rot. Bonds5

About N-[4-methyl-3-(methylsulfamoyl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide

N-[4-methyl-3-(methylsulfamoyl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide (PubChem CID 39441482) has the molecular formula C18H17N3O4S and a molecular weight of 371.42 g/mol. Its IUPAC name is N-[4-methyl-3-(methylsulfamoyl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-[4-methyl-3-(methylsulfamoyl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide
PubChem CID39441482
Molecular FormulaC18H17N3O4S
Molecular Weight371.42 g/mol
Exact Mass371.09
IUPAC NameN-[4-methyl-3-(methylsulfamoyl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide
SMILESCNS(=O)(=O)c1cc(NC(=O)c2cc(-c3ccccc3)on2)ccc1C
InChIInChI=1S/C18H17N3O4S/c1-12-8-9-14(10-17(12)26(23,24)19-2)20-18(22)15-11-16(25-21-15)13-6-4-3-5-7-13/h3-11,19H,1-2H3,(H,20,22)
InChIKeyCZPHVCSTHBOSSK-UHFFFAOYSA-N
XLogP2.81
TPSA101.30 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.42
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-[(3-chlorophenyl)sulfamoyl]-4-methylphenyl]-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 55787366
N-[4-methyl-3-(methylsulfamoyl)phenyl]-3-phenylthiophene-2-carboxamide
CID 78792257
N-[3-(dimethylsulfamoyl)-4-methylphenyl]-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 78884142
N-[4-methyl-3-(methylsulfamoyl)phenyl]quinoline-2-carboxamide
CID 9107051
N-(2,6-dimethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
CID 3073010
N,5-bis(3,4-dimethylphenyl)-1,2-oxazole-3-carboxamide
CID 17011912
2-(3-chlorophenyl)-4-methyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-1,3-thiazole-5-carboxamide
CID 24646825
N-(3-hydroxyphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
CID 1093722
3-ethyl-5-methyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-1,2-oxazole-4-carboxamide
CID 9479423
N-[4-[methyl(phenyl)sulfamoyl]phenyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 17011046
N-[3-[(2-chlorophenyl)sulfamoyl]-4-methylphenyl]-5-(2-methoxyphenyl)-1,2-oxazole-3-carboxamide
CID 46417426
N-(3-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
CID 27285951

Frequently Asked Questions

What is the IUPAC name of N-[4-methyl-3-(methylsulfamoyl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-[4-methyl-3-(methylsulfamoyl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide (CID 39441482) is N-[4-methyl-3-(methylsulfamoyl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-[4-methyl-3-(methylsulfamoyl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-[4-methyl-3-(methylsulfamoyl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide is CNS(=O)(=O)c1cc(NC(=O)c2cc(-c3ccccc3)on2)ccc1C.
What is the InChIKey of N-[4-methyl-3-(methylsulfamoyl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide?
The InChIKey is CZPHVCSTHBOSSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O4S/c1-12-8-9-14(10-17(12)26(23,24)19-2)20-18(22)15-11-16(25-21-15)13-6-4-3-5-7-13/h3-11,19H,1-2H3,(H,20,22).
What are the key properties of N-[4-methyl-3-(methylsulfamoyl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide?
N-[4-methyl-3-(methylsulfamoyl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide has a molecular weight of 371.42 g/mol, XLogP of 2.81, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-methyl-3-(methylsulfamoyl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 39441482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).